| Coupling matrix element of electron self-exchange reactions in solution |
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| 作者姓名： | 步宇翔 刘成卜 邓从豪 |
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| 作者单位： | Institute of Theoretical Chemistry，Shandong University，Jinan，Shandong 250100，China Department of Chemistry，Qufu Normal University，Qufu，Shandong 273165，China，Institute of Theoretical Chemistry，Shandong University，Jinan，Shandong 250100，China，Institute of Theoretical Chemistry，Shandong University，Jinan，Shandong 250100，China |
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| 基金项目： | Project (No. 29673025) supported by the National Natural Science Foundation of China |
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| 摘 要： | On the basis of the common feature among the electron transfer process and the ion hydration process as well as the relevant experimental kinetic data of electron transfer reaction,a new accurate hydration potential function scheme for the determination of electron transfer coupling matrix element is presented.The coupling matrix element between two hydrated ions of the reacting system in solution is calculated.The results and the applicability of this scheme are discussed.
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Coupling matrix element of electron self-exchange reactions in solution |
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| BU,Yu-Xiang LIU,Cheng-BuDENG,Cong-HaoInstitute of Theoretical Chemistry,Shandong University,Jinan,Shandong ,China.Coupling matrix element of electron self-exchange reactions in solution[J].Chinese Journal of Chemistry,1998,16(6):509-513. |
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| Authors: | BU Yu-Xiang LIU Cheng-BuDENG Cong-HaoInstitute of Theoretical Chemistry Shandong University Jinan Shandong China |
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| Institution: | BU,Yu-Xiang LIU,Cheng-BuDENG,Cong-HaoInstitute of Theoretical Chemistry,Shandong University,Jinan,Shandong 250100,China Department of Chemistry,Qufu Normal University,Qufu,Shandong 273165,China |
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| Abstract: | On the basis of the common feature among the electron transfer process and the ion hydration process as well as the relevant experimental kinetic data of electron transfer reaction,a new accurate hydration potential function scheme for the determination of electron transfer coupling matrix element is presented.The coupling matrix element between two hydrated ions of the reacting system in solution is calculated.The results and the applicability of this scheme are discussed. |
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| Keywords: | Electron transfer reaction coupling matrix element nonadiabatic transition hydration potential function |
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